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Home > Boronic Acids > 1451391-89-1
1451391-89-1 | 2-Chloro-4-(methylcarbamoyl)phenylboronic acid
CAS No: 1451391-89-1 Catalog No: AG00HXDM MDL No:
Product Description
Catalog Number:
AG00HXDM
Chemical Name:
2-Chloro-4-(methylcarbamoyl)phenylboronic acid
CAS Number:
1451391-89-1
IUPAC Name:
[2-chloro-4-(methylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C8H9BClNO3/c1-11-8(12)5-2-3-6(9(13)14)7(10)4-5/h2-4,13-14H,1H3,(H,11,12)
InChI Key:
LSMHGCJWZPHACP-UHFFFAOYSA-N
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
213.424g/mol
Monoisotopic Mass:
213.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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